REMARK  Name = BDB000559
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.581   2.402   0.249  0.00  0.00    -0.283 OA
ATOM      2  C   LIG    1        0.684   1.199   0.459  0.00  0.00    +0.233 C 
ENDROOT
BRANCH   2   3
ATOM      3  C   LIG    1        1.875   0.426   0.018  0.00  0.00    +0.026 A 
ATOM      4  C   LIG    1        1.994  -0.952   0.236  0.00  0.00    +0.015 A 
ATOM      5  C   LIG    1        3.127  -1.634  -0.215  0.00  0.00    +0.046 A 
ATOM      6  C   LIG    1        4.134  -0.943  -0.880  0.00  0.00    +0.117 A 
ATOM      7  C   LIG    1        4.032   0.426  -1.103  0.00  0.00    +0.046 A 
ATOM      8  C   LIG    1        2.900   1.110  -0.653  0.00  0.00    +0.015 A 
BRANCH   6   9
ATOM      9  O   LIG    1        5.218  -1.653  -1.300  0.00  0.00    -0.507 OA
ATOM     10  H   LIG    1        5.847  -1.046  -1.723  0.00  0.00    +0.292 HD
ENDBRANCH   6   9
ENDBRANCH   2   3
BRANCH   2  11
ATOM     11  C   LIG    1       -0.455   0.491   1.153  0.00  0.00    +0.233 C 
ATOM     12  O   LIG    1       -0.254   0.013   2.264  0.00  0.00    -0.283 OA
BRANCH  11  13
ATOM     13  C   LIG    1       -1.768   0.358   0.470  0.00  0.00    +0.026 A 
ATOM     14  C   LIG    1       -2.003   0.884  -0.806  0.00  0.00    +0.015 A 
ATOM     15  C   LIG    1       -3.251   0.716  -1.411  0.00  0.00    +0.046 A 
ATOM     16  C   LIG    1       -4.258   0.026  -0.745  0.00  0.00    +0.117 A 
ATOM     17  C   LIG    1       -4.042  -0.501   0.523  0.00  0.00    +0.046 A 
ATOM     18  C   LIG    1       -2.795  -0.335   1.131  0.00  0.00    +0.015 A 
BRANCH  16  19
ATOM     19  O   LIG    1       -5.457  -0.112  -1.378  0.00  0.00    -0.507 OA
ATOM     20  H   LIG    1       -6.068  -0.589  -0.792  0.00  0.00    +0.292 HD
ENDBRANCH  16  19
ENDBRANCH  11  13
ENDBRANCH   2  11
TORSDOF 5